Oxo-[[1-[[4-(Oxoazaniumylmethylidene)Pyridin-1-Yl]Methyl]Pyridin-4-Ylidene]Methyl]Azanium Dibromide
[CAS# 2058-89-1]

Identification

• Name: Oxo-[[1-[[4-(Oxoazaniumylmethylidene)Pyridin-1-Yl]Methyl]Pyridin-4-Ylidene]Methyl]Azanium Dibromide
• Synonyms: Oxo-[[1-[[4-(Oxoazaniumylmethylene)-1-Pyridyl]Methyl]-4-Pyridylidene]Methyl]Ammonium Dibromide; Keto-[[1-[[4-(Ketoazaniumylmethylene)-1-Pyridyl]Methyl]-4-Pyridylidene]Methyl]Ammonium Dibromide; Mmb-4
• Molecular Formula: C₁₃H₁₄Br₂N₄O₂
• Molecular Weight: 418.09
• CAS Registry Number: 2058-89-1
• SMILES: [NH+](=O)\C=C2/C=CN(CN1C=C\C(C=C1)=C\[NH+]=O)C=C2.[Br-].[Br-]
• InChI: 1S/C13H12N4O2.2BrH/c18-14-9-12-1-5-16(6-2-12)11-17-7-3-13(4-8-17)10-15-19;;/h1-10H,11H2;2*1H
• InChIKey: ZKQNRRLCBJUEBC-UHFFFAOYSA-N

Properties

• Boiling point: 374.1°C at 760 mmHg (Cal.)
• Flash point: 180°C (Cal.)